4-[1,3-bis(oxidanylidene)-2-pyridin-4-yl-isoindol-5-yl]sulfonylbenzoate

Systemtic Name: 4-[1,3-bis(oxidanylidene)-2-pyridin-4-yl-isoindol-5-yl]sulfonylbenzoate Openeye Name: 4-[1,3-dioxo-2-(4-pyridyl)isoindolin-5-yl]sulfonylbenzoate CAS Name: 4-[(1,3-dioxo-2-pyridin-4-yl-5-isoindolyl)sulfonyl]benzoate IUPAC Name: 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoate Traditional Name: 4-[1,3-diketo-2-(4-pyridyl)isoindolin-5-yl]sulfonylbenzoate Formula: C20H11N2O6S- MolecularWeight: 407.37614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])S(=O)(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=NC=C4

Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])S(=O)(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=NC=C4

InChI

InChI=1S/C20H12N2O6S/c23-18-16-6-5-15(29(27,28)14-3-1-12(2-4-14)20(25)26)11-17(16)19(24)22(18)13-7-9-21-10-8-13/h1-11H,(H,25,26)/p-1